In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 14th, 2006 | 18 | No |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.66 | 7.13 | -55.46 | 2 | 5 | 1 | 75 | 244.274 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.66 | 7.39 | -128.92 | 3 | 5 | 2 | 77 | 245.282 | 5 | ↓ |